catena-poly[[bis(cis-1-tert-butyltetrazole-κN4)copper(II)]-di-μ-chloro] | 444889-51-4

• 英文名称: catena-poly[[bis(cis-1-tert-butyltetrazole-κN4)copper(II)]-di-μ-chloro]
• CAS: 444889-51-4
• 化学式: C₁₀H₂₀Cl₂CuN₈
• 分子量: 386.774
• InChiKey: HWGUSDYFZLXDRX-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  None
• 重原子数：
  None
• 可旋转键数：
  None
• 环数：
  None
• sp3杂化的碳原子比例：
  None
• 拓扑面积：
  None
• 氢给体数：
  None
• 氢受体数：
  None

反应信息

• 作为产物：
  描述：

  copper(II) choride dihydrate 、 1-(tert-butyl)-1H-tetrazole 以 甲醇 、 异丙醇 、 正丁醇 为溶剂， 生成 catena-poly[[bis(cis-1-tert-butyltetrazole-κN4)copper(II)]-di-μ-chloro]
  参考文献：
  名称：

  catena-Poly[[bis(cis-1-tert-butyltetrazole-κN⁴)copper(II)]-di-μ-chloro]

  摘要：

  The title polymeric compound, [CuCl2(C5H10N4)(2)](n), is the first structurally characterized complex with a bulky 1-alkyl-tetrazole ligand. The coordination polyhedron of the Cu atom is an elongated octahedron. The equatorial positions of the octahedron are occupied by the two Cl atoms, with Cu-Cl distances of 2.2920 (8) and 2.2796 (9) Angstrom, and by the two N-4 atoms of the tetrazole ligands, with Cu-N distances of 2.023 (2) and 2.039 (2) Angstrom. Two symmetry-related Cl atoms occupy the axial positions, at distances of 2.8244 (8) and 3.0174 (8) Angstrom from the Cu atom. The [CuCl2(C5H10N4)(2)] units form infinite chains extended along the b axis, linked together only by van der Waals interactions. The skeleton of each chain consists of Cu and Cl atoms.

  DOI：

  10.1107/s0108270102004754